3,3-Dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one
3,3-dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one
Also Known As: Oprea1_806151|3,3-dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one|KS-00001XNN|3,3-dimethyl-1-(4-methyl-2-nitrophenoxy)-2-butanone|5M-337S|3,3-dimethyl-1-(4-methyl-2-nitro-phenoxy)butan-2-one
CAS: 478048-75-8
| Molecular Formula | C13H17NO4 |
|---|---|
| Molecular Weight | 251.11575 g/mol |
| LogP | 2.89722 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.11575 |
| Monoisotopic Mass | 251.11575 |
| Heavy Atoms | 18 |
| Complexity | 474.36984 |
Chemical Identifiers
| CAS Number | 478048-75-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OCC(=O)C(C)(C)C)[N+](=O)[O-] |
Product Overview
3,3-Dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one (CAS 478048-75-8), with molecular formula C13H17NO4 and molecular weight 251.11575 g/mol. IUPAC: 3,3-dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
3,3-Dimethyl-1-(4-methyl-2-nitrophenoxy)butan-2-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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